HMDB0302135 RDKit 3D Hexahydrocurcumin 53 54 0 0 0 0 0 0 0 0999 V2000 -7.2030 -1.3106 1.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2566 -0.7001 0.1721 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1288 -0.2961 -0.5244 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8488 -0.4530 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7108 -0.0713 -0.6995 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3403 -0.2666 -0.1352 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0319 0.9794 0.6604 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7058 0.9524 1.2874 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3965 1.9241 1.9741 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2511 -0.1676 1.1306 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5278 0.0492 1.8787 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2556 0.1753 3.2366 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4430 -1.1188 1.6786 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8548 -1.3718 0.2665 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6061 -0.2653 -0.3394 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0162 0.7547 -1.0375 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7280 1.8102 -1.6063 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0913 1.8537 -1.4748 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8453 2.8787 -2.0199 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7180 0.8447 -0.7794 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1082 0.8886 -0.6452 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8661 -0.0715 0.0264 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0001 -0.1916 -0.2235 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8827 0.5306 -1.9533 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1440 0.7118 -2.4734 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2657 0.3050 -1.7721 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5621 0.4632 -2.2508 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4566 -0.8427 2.1083 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9412 -2.3771 1.2839 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1973 -1.2813 1.9063 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7469 -0.9232 0.9243 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3463 -1.1763 0.4934 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6398 -0.3355 -0.9791 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1416 1.8399 -0.0364 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8436 1.0994 1.4192 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3733 -0.4153 0.0789 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2475 -1.0672 1.6015 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0278 1.0116 1.5868 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3059 -0.0368 3.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3210 -1.0922 2.3706 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8696 -2.0309 2.0131 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4840 -2.3118 0.2913 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9449 -1.6411 -0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 0.7856 -1.1854 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1812 2.5940 -2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4832 3.6463 -2.5353 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3408 -0.4370 0.9447 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8100 0.4131 0.3526 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1253 -0.9606 -0.5806 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4726 -0.9957 0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9930 0.8466 -2.4948 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2750 1.1850 -3.4594 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6781 0.8969 -3.1555 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 11 12 1 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 18 19 1 0 18 20 1 0 20 21 1 0 21 22 1 0 20 23 2 0 5 24 2 0 24 25 1 0 25 26 2 0 26 27 1 0 26 3 1 0 23 15 1 0 1 28 1 0 1 29 1 0 1 30 1 0 4 31 1 0 6 32 1 0 6 33 1 0 7 34 1 0 7 35 1 0 10 36 1 0 10 37 1 0 11 38 1 0 12 39 1 0 13 40 1 0 13 41 1 0 14 42 1 0 14 43 1 0 16 44 1 0 17 45 1 0 19 46 1 0 22 47 1 0 22 48 1 0 22 49 1 0 23 50 1 0 24 51 1 0 25 52 1 0 27 53 1 0 M END